![4-TERT-BUTYLCALIX[5]ARENE structure, CAS 81475-22-1](/structures/210000/188034_1_81475_22_1.png)
CAS Number81475-22-1
Synonymspara-tert-butylcalix[5]arene; 5,11,17,23,29-pentakis(1,1-dimethylethyl)-35,36,37,38,39-pentahydroxycalix[5]arene; p-t-butylcalix[5]arene; MFCD00210028; Penta-tert-butyl(pentahydroxy)calix[5]arene; B2221; p-tert-butylcalix<5>arene
Molecular FormulaC55H70O5
Molecular Weight811.16
Density1.1±0.1 g/cm3
Boiling Point792.3±60.0 °C at 760 mmHg
Melting Point310-312ºC(lit.)
AppearanceWhite to light brown crystalline powder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 81475-22-1 |
| Catalog No. | 2A-3186708 |
| Chinese Name | 对叔丁基5杯芳烃 |
| Synonyms | para-tert-butylcalix[5]arene; 5,11,17,23,29-pentakis(1,1-dimethylethyl)-35,36,37,38,39-pentahydroxycalix[5]arene; p-t-butylcalix[5]arene; MFCD00210028; Penta-tert-butyl(pentahydroxy)calix[5]arene; B2221; p-tert-butylcalix<5>arene |
| Molecular Formula | C55H70O5 |
| Molecular Weight | 811.16 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 792.3±60.0 °C at 760 mmHg |
| Melting Point | 310-312ºC(lit.) |
| Appearance | White to light brown crystalline powder |
| Storage Condition | Sealed, cool, dry place |
| PubChem ID | 3141740 |
| MDL Number | MFCD00210028 |
| SMILES | CC(C)(C)c1cc2c(O)c(c1)Cc1cc(C(C)(C)C)cc(c1O)Cc1cc(C(C)(C)C)cc(c1O)Cc1cc(C(C)(C)C)cc(c1O)Cc1cc(C(C)(C)C)cc(c1O)C2 |
| InChI | InChI=1S/C55H70O5/c1-51(2,3)41-21-31-16-33-23-42(52(4,5)6)25-35(47(33)57)18-37-27-44(54(10,11)12)29-39(49(37)59)20-40-30-45(55(13,14)15)28-38(50(40)60)19-36-26-43(53(7,8)9)24-34(48(36)58)17-32(22-41)46(31)56/h21-30,56-60H,16-20H2,1-15H3 |
| InChI Key | HTJNUHSOASZVHV-UHFFFAOYSA-N |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: inconsistent with United Nations classification standards UN number: not specified 4-tert-Butylcalix[5]arene Modification number: 5 |
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